4-nitro-N-(4-nitrophenyl)benzenecarbothioamide

Systemtic Name: 4-nitro-N-(4-nitrophenyl)benzenecarbothioamide Openeye Name: 4-nitro-N-(4-nitrophenyl)benzenecarbothioamide CAS Name: 4-nitro-N-(4-nitrophenyl)benzenecarbothioamide IUPAC Name: 4-nitro-N-(4-nitrophenyl)benzenecarbothioamide Traditional Name: 4-nitro-N-(4-nitrophenyl)thiobenzamide Formula: C13H9N3O4S MolecularWeight: 303.29326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=S)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=S)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O4S/c17-15(18)11-5-1-9(2-6-11)13(21)14-10-3-7-12(8-4-10)16(19)20/h1-8H,(H,14,21)